⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL30780331 | 0.87 | TYK2 (0.36) | — | |
| SCHEMBL30780310 | 0.84 | SYK (0.37) | — | |
| SCHEMBL26983726 | 0.84 | SYK (0.37) | — | |
| SCHEMBL30780446 | 0.79 | TYK2 (0.45) | — | |
| SCHEMBL26983737 | 0.79 | TYK2 (0.45) | — | |
| SCHEMBL30780336 | 0.79 | TYK2 (0.36) | — | |
| SCHEMBL30780305 | 0.76 | TYK2 (0.34) | — | |
| SCHEMBL30780345 | 0.75 | TYK2 (0.44) | — | |
| SCHEMBL24783784 | 0.74 | JAK2 (0.41) | — | |
| SCHEMBL30119819 | 0.73 | RET (0.33) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4551559-A1 | HETEROARYL COMPOUNDS AS INHIBITORS OF TYK2/JAK1, COMPOSITION AND APPLICATION THEREOF | Accro Bioscience (HK) Limited (HK) | 2025-05-14 | — | — | EP | disclosed |
| WO-2024010963-A1 | HETEROARYL COMPOUNDS AS INHIBITORS OF TYK2/JAK1, COMPOSITION AND APPLICATION THEREOF | ACCRO BIOSCIENCE (HK) LIMITED (CN) | 2024-01-11 | — | — | WO | disclosed |